Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01664962
Compound Identification
Common NamePS(20:4(5Z,8Z,11Z,14Z)-OH(17)/18:1(9Z))
Structure
Average Molecular Weight825.5156
SMILES[H][C@@](COC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CC(O)CCC)(COP(O)(=O)OC[C@H](N)C(O)=O)OC(=O)CCCCCCC\C=C/CCCCCCCC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5838.9062
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices